| SpectraBase Compound ID | 3cweAGtCahU |
|---|---|
| InChI | InChI=1S/C13H22O2/c1-2-3-5-10-12(13(14)15)11-8-6-4-7-9-11/h2,11-12H,1,3-10H2,(H,14,15) |
| InChIKey | WKXHLRXIPDKAHQ-UHFFFAOYSA-N |
| Mol Weight | 210.32 g/mol |
| Molecular Formula | C13H22O2 |
| Exact Mass | 210.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7TVlGBQ0UwV |
|---|---|
| Name | 2-Cyclohexyl-6-heptenoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.161979946 u |
| Formula | C13H22O2 |
| InChI | InChI=1S/C13H22O2/c1-2-3-5-10-12(13(14)15)11-8-6-4-7-9-11/h2,11-12H,1,3-10H2,(H,14,15) |
| InChIKey | WKXHLRXIPDKAHQ-UHFFFAOYSA-N |
| Molecular Weight | 210.317 g/mol |
| SMILES | C(C(C1CCCCC1)CCCC=C)(=O)O |